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2-(5-Isoxazolyl)-4-methylphenol
SpectraBase Compound ID 9sSPezZQeIK
InChI InChI=1S/C10H9NO2/c1-7-2-3-9(12)8(6-7)10-4-5-11-13-10/h2-6,12H,1H3
InChIKey OZKYVNKXVHASGF-UHFFFAOYSA-N
Mol Weight 175.19 g/mol
Molecular Formula C10H9NO2
Exact Mass 175.063329 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 13aWNuiMP2n
Name 2-(5-Isoxazolyl)-4-methylphenol
Source of Sample Alfa Aesar, Thermo Fisher Scientific
Catalog Number H27204
Lot Number 10143709
Accessory TRANS *14560FA0
Acquisition Mode double sided, forward-backward
Actual Signal Gain 2
Actual Signal Gain 2nd Channel 1
Additional Data Treatment 0
Analog Signal 1 0.27038
Analog Signal 2 0
Aperture Setting 6 mm
Apodization Function Norton-Beer, medium
Background Measurement Channel Sample Compartment
Background Peak Amplitude 2nd Channel 1
Background Peak Location 2nd Channel 1
Background Scans 32
Background Scans or Time Scans
Backward Peak Amplitude -10168
Backward Peak Location 14449
Beam Splitter Setting KBr
CAS Registry Number 164171-56-6
Container ID C-009749
Copyright Copyright © 2018-2024 John Wiley & Sons, Inc. All Rights Reserved.
Data Point Format 1
Delay Before Measurement 0 s
Detector Setting RT-DLaTGS [Internal]
End Frequency Limit for File 340
External Synchronization Off
Focal Length 100
Formula C10H9NO2
Frequency of First Point 3999.54 cm⁻¹
Frequency of Last Point 339.945 cm⁻¹
High Folding Limit 15800.5
High Frequency Limit 8000 cm⁻¹
High Pass Filter 0
InChI InChI=1S/C10H9NO2/c1-7-2-3-9(12)8(6-7)10-4-5-11-13-10/h2-6,12H,1H3
InChIKey OZKYVNKXVHASGF-UHFFFAOYSA-N
Instrument Name Bruker Tensor 27 FT-IR
KBr Capsule ID K-04880
Laser Wavenumber 15800.5 cm⁻¹
Low Folding Limit 0
Low Frequency Limit 0
Low Pass Filter 10
Molecular Weight 175.187 g/mol
Non Linearity Correction 0
Number of Points 15180
Number of Sample Scans 32
Optical Filter Setting Open
Peak Amplitude -10147
Peak Amplitude 2nd Channel 1
Peak Location 14506
Peak Location 2nd Channel 1
Pellet ID P-04592
Phase Correction Mode Mertz
Phase Resolution 4
Physical State Solid
Preamplifier Gain Background 0
Purity 98%
Relative Humidity Interferometer 20 %
Resolution 2
SKU H27204-5G
SMILES Oc1c(cc(cc1)C)-c1ccno1
Sample Capsule ID S-04880
Sample Spacing Divisor 1
Sample Spacing Multiplicator 1
Scan Time 50.045 s
Scanner Temperature 27.9 °C
Scanner Velocity 10 kHz
Signal Gain, Background automatic
Source of Spectrum Bio-Rad Laboratories, Inc.
Start Frequency Limit for File 4000 cm⁻¹
Synonyms 5-(2-Hydroxy-5-methylphenyl)isoxazole; (6E)-4-Methyl-6-(2H-1,2-oxazol-5-ylidene)cyclohexa-2,4-dien-1-one
Technique KBr1
Zero Filling Factor 8